3-[3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]indol-1-yl]propyl-dimethyl-azanium chloride

Systemtic Name: 3-[3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]indol-1-yl]propyl-dimethyl-azanium chloride Openeye Name: 3-[3-[1-[bis(4-methoxyphenyl)methylene]propyl]indol-1-yl]propyl-dimethyl-ammonium chloride CAS Name: 3-[3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]-1-indolyl]propyl-dimethylammonium chloride IUPAC Name: 3-[3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]indol-1-yl]propyl-dimethylazanium chloride Traditional Name: 3-[3-[1-ethyl-2,2-bis(4-methoxyphenyl)vinyl]indol-1-yl]propyl-dimethyl-ammonium chloride Formula: C31H37ClN2O2 MolecularWeight: 505.09068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C3=CN(C4=CC=CC=C43)CCC[NH+](C)C.[Cl-]

Isomeric SMILES

CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C3=CN(C4=CC=CC=C43)CCC[NH+](C)C.[Cl-]

InChI

InChI=1S/C31H36N2O2.ClH/c1-6-27(29-22-33(21-9-20-32(2)3)30-11-8-7-10-28(29)30)31(23-12-16-25(34-4)17-13-23)24-14-18-26(35-5)19-15-24;/h7-8,10-19,22H,6,9,20-21H2,1-5H3;1H